Ethanol → HCID 22170140, compound
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[c:7](-[c:12]2[c:13]([Cl:19])[cH:14][n:15][cH:16][c:17]2[Cl:18])[n:8][o:9][c:10]1[CH3:11].[CH3:22][CH2:23][OH:24].[Na+:21].[O:25]1[CH2:26][CH2:27][CH2:28][CH2:29]1.[OH-:20]>>[O:3]=[C:4]([OH:5])[c:6]1[c:7](-[c:12]2[c:13]([Cl:19])[cH:14][n:15][cH:16][c:17]2[Cl:18])[n:8][o:9][c:10]1[CH3:11]Participants
6
Sources & evidence
- ORD record
- ord-a943e3213d094fe9b5f1b833a095badf
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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